SCHEMBL31638366

SCHEMBL31638366

Cn1ncc2cc(CCO)ccc21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 3/20 0.58
TCF7 P36402 1/20 0.58
MPO P05164 1/20 0.45
CCNC P24863 2/20 0.44
CDK8 P49336 2/20 0.44
HTR2A P28223 1/20 0.44
PASK Q96RG2 1/20 0.44
CDK19 Q9BWU1 1/20 0.44
CACNA1H O95180 8/20 0.44
CACNA1G O43497 3/20 0.44
CACNA1I Q9P0X4 3/20 0.44
MET P08581 1/20 0.43
SLC5A2 P31639 1/20 0.42
TCF4 P15884 2/20 0.42
TRPM5 Q9NZQ8 1/20 0.42
CDH1 P12830 1/20 0.42
TCF7L2 Q9NQB0 1/20 0.42
DRD4 P21917 1/20 0.41
TMEM97 Q5BJF2 1/20 0.41
SIGMAR1 Q99720 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1665815 0.86 CTNNB1 (0.54) CTNNB1TCF7MPOCCNCCDK8
SCHEMBL29491495 0.86 CTNNB1 (0.54) CTNNB1TCF7MPOCCNCCDK8
SCHEMBL8220146 0.85 CTNNB1 (0.59) CTNNB1TCF7MPOCCNCCDK8
SCHEMBL13476250 0.83 CTNNB1 (0.58) CTNNB1TCF7MPOCCNCCDK8
SCHEMBL31638220 0.83 CTNNB1 (0.58) CTNNB1TCF7MPOCCNCCDK8
SCHEMBL19991900 0.82 CTNNB1 (0.57) CTNNB1TCF7MPOCCNCCDK8
SCHEMBL8179108 0.81 CTNNB1 (0.55) CTNNB1TCF7MPOCCNCCDK8
SCHEMBL6340738 0.81 CTNNB1 (0.56) CTNNB1TCF7MPOCCNCCDK8
SCHEMBL14402843 0.81 CTNNB1 (0.56) CTNNB1TCF7MPOCCNCCDK8
SCHEMBL16406917 0.80 CTNNB1 (0.54) CTNNB1TCF7MPOCCNCCDK8

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025137307-A1 HETEROCYCLIC GLP-1 AGONISTS GASHERBRUM BIO, INC. (US) 2025-06-26 WO disclosed